# generated using pymatgen
data_Ti2MoIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.40266133
_cell_length_b   4.40266136
_cell_length_c   4.40266073
_cell_angle_alpha   59.99991993
_cell_angle_beta   59.99991250
_cell_angle_gamma   59.99992296
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2MoIr
_chemical_formula_sum   'Ti2 Mo1 Ir1'
_cell_volume   60.34342849
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Ti  Ti0  1  -0.00000003  -0.00000001  -0.00000001  1.0
  Ti  Ti1  1  0.50000077  0.50000079  0.50000079  1.0
  Mo  Mo2  1  0.74999924  0.74999922  0.74999922  1.0
  Ir  Ir3  1  0.25000002  0.25000000  0.25000000  1.0